SCHEMBL9692238

SCHEMBL9692238

CCCCC1(C)OC1C(=O)OCC

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.37
POLB P06746 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
LMNA P02545 1/20 0.36
PPM1B O75688 1/20 0.36
PTPN1 P18031 1/20 0.36
PPP1CC P36873 1/20 0.36
RAB9A P51151 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL9692233 0.84 POLA1 (0.37) POLBRAB9A
SCHEMBL2139493 0.82 LMNA (0.40) ALDH1A1POLBLMNAPPM1BPTPN1
SCHEMBL9690164 0.78 POLA1 (0.44) POLBRAB9A
SCHEMBL14967933 0.76 ALDH1A1 (0.42) ALDH1A1POLBL3MBTL1LMNAPPM1B
SCHEMBL900783 0.75 LMNA (0.43) ALDH1A1POLBLMNAPPM1BPTPN1
SCHEMBL28451820 0.74 ALOX15 (0.44) ALDH1A1LMNA
SCHEMBL14967185 0.73 NAAA (0.44)
SCHEMBL14967693 0.71 PPM1B (0.42) ALDH1A1LMNAPPM1BPTPN1PPP1CC
SCHEMBL9120224 0.70 LMNA (0.33) ALDH1A1POLBLMNAPPM1BPTPN1
SCHEMBL14967555 0.69 ALDH1A1 (0.47) ALDH1A1POLBL3MBTL1LMNA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0153692-B1 METHOD FOR ISOMERIZATION A GLYCIDATE DERIVATIVE SAGAMI CHEMICAL RESEARCH CENTER (JP) 1992-07-29 EP disclosed
US-4621150-A METAL PERHALATE OR SULFONATE OR COMPLEX; GLYCIDATE, 2-HYDROXY-3-BUTENOATE, EPOXIDE SAGAMI CHEMICAL RESEARCH CENTER (JP) 1986-11-04 US disclosed
EP-0153692-A2 Method for isomerization a glycidate derivative SAGAMI CHEMICAL RESEARCH CENTER (JP) 1985-09-04 EP disclosed